ChemSpider 2D Image | 5-Methyl-1H-pyrazolo[3,4-b]pyridine-1-propanenitrile | C10H10N4

5-Methyl-1H-pyrazolo[3,4-b]pyridine-1-propanenitrile

  • Molecular FormulaC10H10N4
  • Average mass186.213 Da
  • Monoisotopic mass186.090546 Da
  • ChemSpider ID21805282

More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1160246-32-1 [RN]
1H-Pyrazolo[3,4-b]pyridine-1-propanenitrile, 5-methyl- [ACD/Index Name]
3-(5-Methyl-1H-pyrazolo[3,4-b]pyridin-1-yl)propanenitrile [ACD/IUPAC Name]
3-(5-Méthyl-1H-pyrazolo[3,4-b]pyridin-1-yl)propanenitrile [French] [ACD/IUPAC Name]
3-(5-Methyl-1H-pyrazolo[3,4-b]pyridin-1-yl)propannitril [German] [ACD/IUPAC Name]
3-{5-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl}propanenitrile
3-{5-methylpyrazolo[3,4-b]pyridin-1-yl}propanenitrile
5-Methyl-1H-pyrazolo[3,4-b]pyridine-1-propanenitrile
3-(5-methylpyrazolo[3,4-b]pyridin-1-yl)propanenitrile
3-(5-methylpyrazolo[5,4-b]pyridinyl)propanenitrile
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 386.5±32.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 63.5±3.0 kJ/mol
    Flash Point: 187.5±25.1 °C
    Index of Refraction: 1.645
    Molar Refractivity: 55.3±0.5 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 0.51
    ACD/LogD (pH 5.5): 0.97
    ACD/BCF (pH 5.5): 3.21
    ACD/KOC (pH 5.5): 79.90
    ACD/LogD (pH 7.4): 0.98
    ACD/BCF (pH 7.4): 3.25
    ACD/KOC (pH 7.4): 80.83
    Polar Surface Area: 55 Å2
    Polarizability: 21.9±0.5 10-24cm3
    Surface Tension: 49.1±7.0 dyne/cm
    Molar Volume: 152.7±7.0 cm3

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